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GLASS

You can:

Check the ligand table for details.
Go to the GPCR list to see GPCRs with which this ligand interacts.
Go to the individual GPCR page for PubMed ID information by text mining.
Download a TSV version of all interaction data.
Go back to previous page.

Ligand

Name	UNII-V423P4PL29
Molecular formula	C21H20N4O
IUPAC name	2-[(1E,3E)-5-oxo-5-(4-pyridin-2-ylpiperazin-1-yl)penta-1,3-dienyl]benzonitrile
Molecular weight	344.418
Hydrogen bond acceptor	4
Hydrogen bond donor	0
XlogP	3.0
Synonyms	Benzonitrile, 2-((1E,3E)-5-oxo-5-(4-(2-pyridinyl)-1-piperazinyl)-1,3-pentadien-1-yl)- F-16618 V423P4PL29 F-16618 free base 960490-97-5 CHEMBL561338 [ Show all ]
Inchi Key	GDMFQEYMRVQWAD-BZKLWIKRSA-N
Inchi ID	InChI=1S/C21H20N4O/c22-17-19-9-2-1-7-18(19)8-3-4-11-21(26)25-15-13-24(14-16-25)20-10-5-6-12-23-20/h1-12H,13-16H2/b8-3+,11-4+
PubChem CID	23658168
ChEMBL	CHEMBL561338
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Known GPCRs

You can:

Click GLASS IDs to check the association information.
Click protein names to check details of the GPCRs.
Download a TSV version of all interaction information.

GLASS ID	Name	UniProt	Gene	Species	Length
93771	Proteinase-activated receptor 1	P25116	F2R	Homo sapiens (Human)	425
93773	Proteinase-activated receptor 2	P55085	F2RL1	Homo sapiens (Human)	397
93772	Proteinase-activated receptor 4	Q96RI0	F2RL3	Homo sapiens (Human)	385

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